3-(benzenesulfonyl)-N-(4-chlorophenyl)-8-methoxy-2H-1-benzopyran-2-imine
Chemical Structure Depiction of
3-(benzenesulfonyl)-N-(4-chlorophenyl)-8-methoxy-2H-1-benzopyran-2-imine
3-(benzenesulfonyl)-N-(4-chlorophenyl)-8-methoxy-2H-1-benzopyran-2-imine
Compound characteristics
| Compound ID: | C585-0110 |
| Compound Name: | 3-(benzenesulfonyl)-N-(4-chlorophenyl)-8-methoxy-2H-1-benzopyran-2-imine |
| Molecular Weight: | 425.89 |
| Molecular Formula: | C22 H16 Cl N O4 S |
| Smiles: | COc1cccc2C=C(/C(=N/c3ccc(cc3)[Cl])Oc12)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.63 |
| logD: | 4.6299 |
| logSw: | -5.0035 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.76 |
| InChI Key: | KEMMYBHJRIQTHP-UHFFFAOYSA-N |